2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine

C24H24ClN5O2 — CID 135334884

IUPAC2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine
SMILESCOc1cc(OC)c(-c2cn3ccc(N4CCN(c5ccccn5)CC4)cc3n2)cc1Cl
InChIInChI=1S/C24H24ClN5O2/c1-31-21-15-22(32-2)19(25)14-18(21)20-16-30-8-6-17(13-24(30)27-20)28-9-11-29(12-10-28)23-5-3-4-7-26-23/h3-8,13-16H,9-12H2,1-2H3
InChIKeyJEUFAJCGFCMHQH-UHFFFAOYSA-N
MW449.94 g/mol
LogP4.39
Rot. Bonds5

About 2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine

2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine (PubChem CID 135334884) has the molecular formula C24H24ClN5O2 and a molecular weight of 449.94 g/mol. Its IUPAC name is 2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine
PubChem CID135334884
Molecular FormulaC24H24ClN5O2
Molecular Weight449.94 g/mol
Exact Mass449.16
IUPAC Name2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine
SMILESCOc1cc(OC)c(-c2cn3ccc(N4CCN(c5ccccn5)CC4)cc3n2)cc1Cl
InChIInChI=1S/C24H24ClN5O2/c1-31-21-15-22(32-2)19(25)14-18(21)20-16-30-8-6-17(13-24(30)27-20)28-9-11-29(12-10-28)23-5-3-4-7-26-23/h3-8,13-16H,9-12H2,1-2H3
InChIKeyJEUFAJCGFCMHQH-UHFFFAOYSA-N
XLogP4.39
TPSA55.13 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.94
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine (CID 135334884) is 2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine is COc1cc(OC)c(-c2cn3ccc(N4CCN(c5ccccn5)CC4)cc3n2)cc1Cl.
What is the InChIKey of 2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine?
The InChIKey is JEUFAJCGFCMHQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24ClN5O2/c1-31-21-15-22(32-2)19(25)14-18(21)20-16-30-8-6-17(13-24(30)27-20)28-9-11-29(12-10-28)23-5-3-4-7-26-23/h3-8,13-16H,9-12H2,1-2H3.
What are the key properties of 2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine?
2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine has a molecular weight of 449.94 g/mol, XLogP of 4.39, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-pyridin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 135334884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).